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Nonnegative Matrix Factorization through Cone Collapse

arXiv.org Artificial Intelligence

Nonnegative matrix factorization (NMF) is a widely used tool for learning parts-based, low-dimensional representations of nonnegative data, with applications in vision, text, and bioinformatics. In clustering applications, orthogonal NMF (ONMF) variants further impose (approximate) orthogonality on the representation matrix so that its rows behave like soft cluster indicators. Existing algorithms, however, are typically derived from optimization viewpoints and do not explicitly exploit the conic geometry induced by NMF: data points lie in a convex cone whose extreme rays encode fundamental directions or "topics". In this work we revisit NMF from this geometric perspective and propose Cone Collapse, an algorithm that starts from the full nonnegative orthant and iteratively shrinks it toward the minimal cone generated by the data. We prove that, under mild assumptions on the data, Cone Collapse terminates in finitely many steps and recovers the minimal generating cone of $\mathbf{X}^\top$ . Building on this basis, we then derive a cone-aware orthogonal NMF model (CC-NMF) by applying uni-orthogonal NMF to the recovered extreme rays. Across 16 benchmark gene-expression, text, and image datasets, CC-NMF consistently matches or outperforms strong NMF baselines-including multiplicative updates, ANLS, projective NMF, ONMF, and sparse NMF-in terms of clustering purity. These results demonstrate that explicitly recovering the data cone can yield both theoretically grounded and empirically strong NMF-based clustering methods.




Optimally Teaching a Linear Behavior Cloning Agent

arXiv.org Artificial Intelligence

We study optimal teaching of Linear Behavior Cloning (LBC) learners. In this setup, the teacher can select which states to demonstrate to an LBC learner. The learner maintains a version space of infinite linear hypotheses consistent with the demonstration. The goal of the teacher is to teach a realizable target policy to the learner using minimum number of state demonstrations. This number is known as the Teaching Dimension(TD). We present a teaching algorithm called ``Teach using Iterative Elimination(TIE)" that achieves instance optimal TD. However, we also show that finding optimal teaching set computationally is NP-hard. We further provide an approximation algorithm that guarantees an approximation ratio of $\log(|A|-1)$ on the teaching dimension. Finally, we provide experimental results to validate the efficiency and effectiveness of our algorithm.


Neural Network Verification as Piecewise Linear Optimization: Formulations for the Composition of Staircase Functions

arXiv.org Artificial Intelligence

We present a technique for neural network verification using mixed-integer programming (MIP) formulations. We derive a \emph{strong formulation} for each neuron in a network using piecewise linear activation functions. Additionally, as in general, these formulations may require an exponential number of inequalities, we also derive a separation procedure that runs in super-linear time in the input dimension. We first introduce and develop our technique on the class of \emph{staircase} functions, which generalizes the ReLU, binarized, and quantized activation functions. We then use results for staircase activation functions to obtain a separation method for general piecewise linear activation functions. Empirically, using our strong formulation and separation technique, we can reduce the computational time in exact verification settings based on MIP and improve the false negative rate for inexact verifiers relying on the relaxation of the MIP formulation.


Persistent Reductions in Regularized Loss Minimization for Variable Selection

arXiv.org Machine Learning

In the context of regularized loss minimization with polyhedral gauges, we show that for a broad class of loss functions (possibly non-smooth and non-convex) and under a simple geometric condition on the input data it is possible to efficiently identify a subset of features which are guaranteed to have zero coefficients in all optimal solutions in all problems with loss functions from said class, before any iterative optimization has been performed for the original problem. This procedure is standalone, takes only the data as input, and does not require any calls to the loss function. Therefore, we term this procedure as a persistent reduction for the aforementioned class of regularized loss minimization problems. This reduction can be efficiently implemented via an extreme ray identification subroutine applied to a polyhedral cone formed from the datapoints. We employ an existing output-sensitive algorithm for extreme ray identification which makes our guarantee and algorithm applicable in ultra-high dimensional problems.


Efficiently testing local optimality and escaping saddles for ReLU networks

arXiv.org Machine Learning

We provide a theoretical algorithm for checking local optimality and escaping saddles at nondifferentiable points of empirical risks of two-layer ReLU networks. Our algorithm receives any parameter value and returns: local minimum, second-order stationary point, or a strict descent direction. The presence of M data points on the nondifferentiability of the ReLU divides the parameter space into at most 2^M regions, which makes analysis difficult. By exploiting polyhedral geometry, we reduce the total computation down to one convex quadratic program (QP) for each hidden node, O(M) (in)equality tests, and one (or a few) nonconvex QP. For the last QP, we show that our specific problem can be solved efficiently, in spite of nonconvexity. In the benign case, we solve one equality constrained QP, and we prove that projected gradient descent solves it exponentially fast. In the bad case, we have to solve a few more inequality constrained QPs, but we prove that the time complexity is exponential only in the number of inequality constraints. Our experiments show that either benign case or bad case with very few inequality constraints occurs, implying that our algorithm is efficient in most cases.


Unsupervised clustering under the Union of Polyhedral Cones (UOPC) model

arXiv.org Machine Learning

In this paper, we consider clustering data that is assumed to come from one of finitely many pointed convex polyhedral cones. This model is referred to as the Union of Polyhedral Cones (UOPC) model. Similar to the Union of Subspaces (UOS) model where each data from each subspace is generated from a (unknown) basis, in the UOPC model each data from each cone is assumed to be generated from a finite number of (unknown) \emph{extreme rays}.To cluster data under this model, we consider several algorithms - (a) Sparse Subspace Clustering by Non-negative constraints Lasso (NCL), (b) Least squares approximation (LSA), and (c) K-nearest neighbor (KNN) algorithm to arrive at affinity between data points. Spectral Clustering (SC) is then applied on the resulting affinity matrix to cluster data into different polyhedral cones. We show that on an average KNN outperforms both NCL and LSA and for this algorithm we provide the deterministic conditions for correct clustering. For an affinity measure between the cones it is shown that as long as the cones are not very coherent and as long as the density of data within each cone exceeds a threshold, KNN leads to accurate clustering. Finally, simulation results on real datasets (MNIST and YaleFace datasets) depict that the proposed algorithm works well on real data indicating the utility of the UOPC model and the proposed algorithm.


First Order Methods for Robust Non-negative Matrix Factorization for Large Scale Noisy Data

arXiv.org Machine Learning

Nonnegative matrix factorization (NMF) has been shown to be identifiable under the separability assumption, under which all the columns(or rows) of the input data matrix belong to the convex cone generated by only a few of these columns(or rows) [1]. In real applications, however, such separability assumption is hard to satisfy. Following [4] and [5], in this paper, we look at the Linear Programming (LP) based reformulation to locate the extreme rays of the convex cone but in a noisy setting. Furthermore, in order to deal with the large scale data, we employ First-Order Methods (FOM) to mitigate the computational complexity of LP, which primarily results from a large number of constraints. We show the performance of the algorithm on real and synthetic data sets.


Robust Large Scale Non-negative Matrix Factorization using Proximal Point Algorithm

arXiv.org Machine Learning

A robust algorithm for non-negative matrix factorization (NMF) is presented in this paper with the purpose of dealing with large-scale data, where the separability assumption is satisfied. In particular, we modify the Linear Programming (LP) algorithm of [9] by introducing a reduced set of constraints for exact NMF. In contrast to the previous approaches, the proposed algorithm does not require the knowledge of factorization rank (extreme rays [3] or topics [7]). Furthermore, motivated by a similar problem arising in the context of metabolic network analysis [13], we consider an entirely different regime where the number of extreme rays or topics can be much larger than the dimension of the data vectors. The performance of the algorithm for different synthetic data sets are provided.